1-(diphenylmethyl)-N-[2-[(3R)-3-phenylpyrrolidin-1-ium-1-yl]ethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(diphenylmethyl)-N-[2-[(3R)-3-phenylpyrrolidin-1-ium-1-yl]ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzhydryl-N-[2-[(3R)-3-phenylpyrrolidin-1-ium-1-yl]ethyl]triazole-4-carboxamide CAS Name: 1-(diphenylmethyl)-N-[2-[(3R)-3-phenyl-1-pyrrolidin-1-iumyl]ethyl]-4-triazolecarboxamide IUPAC Name: 1-benzhydryl-N-[2-[(3R)-3-phenylpyrrolidin-1-ium-1-yl]ethyl]triazole-4-carboxamide Traditional Name: 1-benzhydryl-N-[2-[(3R)-3-phenylpyrrolidin-1-ium-1-yl]ethyl]triazole-4-carboxamide Formula: C28H30N5O+ MolecularWeight: 452.5707

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1C2=CC=CC=C2)CCNC(=O)C3=CN(N=N3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](C[C@H]1C2=CC=CC=C2)CCNC(=O)C3=CN(N=N3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N5O/c34-28(29-17-19-32-18-16-25(20-32)22-10-4-1-5-11-22)26-21-33(31-30-26)27(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,21,25,27H,16-20H2,(H,29,34)/p+1/t25-/m0/s1